#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1x02 h ASP 2 N 0.00 0.00 -0.41 0.00 3.32 -2.11 -3.04 116.42 114.18 1x02 h ASP 2 Ca 0.00 0.00 -0.18 0.00 0.02 0.00 0.00 57.03 56.87 1x02 h ASP 2 Cb 0.00 0.00 -0.11 0.00 0.22 0.00 0.00 39.33 39.44 1x02 h ASP 2 CO 0.00 0.31 0.23 0.00 -1.72 0.00 0.00 179.24 178.06 1x02 n GLN 3 N -3.35 1.87 -3.15 3.56 6.02 -1.26 -4.66 117.38 116.42 1x02 n GLN 3 Ca 0.01 -1.40 0.05 0.00 -0.01 0.00 0.00 57.00 55.65 1x02 n GLN 3 Cb 0.53 -1.62 -0.01 0.00 1.02 0.00 0.00 30.24 30.16 1x02 n GLN 3 CO 0.00 0.00 0.00 -0.48 -1.01 0.00 0.00 177.06 175.57 1x02 s LEU 4 N -1.45 -0.82 0.22 1.08 2.34 -1.15 -4.87 118.68 114.02 1x02 s LEU 4 Ca 0.26 0.35 0.00 0.00 0.06 0.00 0.00 54.13 54.80 1x02 s LEU 4 Cb 0.21 1.62 0.00 0.00 -0.56 0.00 0.00 46.19 47.47 1x02 s LEU 4 CO 0.06 -0.15 0.00 0.41 -1.06 0.00 0.00 176.35 175.60 1x02 n THR 5 N 5.38 0.50 0.00 5.48 -1.04 -1.26 -4.91 114.28 118.42 1x02 n THR 5 Ca -0.01 0.16 0.00 0.00 -2.04 0.00 0.00 64.05 62.17 1x02 n THR 5 Cb 0.54 -0.94 0.00 0.00 -1.82 0.00 0.00 70.33 68.11 1x02 n THR 5 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 1x02 n GLU 6 N -3.49 1.12 0.17 -2.82 1.02 -1.26 -4.52 120.64 110.86 1x02 n GLU 6 Ca 0.00 0.00 0.02 0.00 -0.02 0.00 0.00 57.16 57.16 1x02 n GLU 6 Cb 0.00 -0.68 0.35 0.00 -0.02 0.00 0.00 31.44 31.08 1x02 n GLU 6 CO 0.00 0.00 0.00 1.05 1.18 0.00 0.00 177.13 179.36 1x02 h GLU 7 N 0.00 0.03 0.00 3.49 9.09 -1.97 -2.59 114.58 122.63 1x02 h GLU 7 Ca 0.00 -0.01 0.00 0.00 0.05 0.00 0.00 59.36 59.40 1x02 h GLU 7 Cb 0.37 -0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.46 1x02 h GLU 7 CO 0.00 0.40 -0.43 1.04 0.05 0.00 0.00 179.01 180.07 1x02 n GLN 8 N -4.09 0.35 -0.33 1.06 1.13 -1.26 -3.77 117.38 110.46 1x02 n GLN 8 Ca -0.02 0.43 0.23 0.00 -1.94 0.00 0.00 57.00 55.70 1x02 n GLN 8 Cb 0.41 -1.44 0.44 0.00 0.11 0.00 0.00 30.24 29.76 1x02 n GLN 8 CO 0.00 0.00 0.00 0.82 -1.44 0.00 0.00 177.06 176.44 1x02 h ILE 9 N -0.76 0.06 -0.03 5.09 5.03 -1.80 0.49 117.51 125.60 1x02 h ILE 9 Ca 0.00 -0.02 -0.00 0.00 -0.12 0.00 0.00 64.86 64.72 1x02 h ILE 9 Cb 0.43 0.01 -0.00 0.00 -3.03 0.00 0.00 36.82 34.22 1x02 h ILE 9 CO 0.00 0.01 0.02 0.00 -0.68 0.00 0.00 178.15 177.50 1x02 h ALA 10 N 1.96 0.03 -0.78 1.87 0.00 -1.66 0.15 119.26 120.84 1x02 h ALA 10 Ca 0.72 -0.03 0.04 0.00 0.00 0.00 0.00 54.91 55.64 1x02 h ALA 10 Cb 1.70 -0.01 -0.05 0.00 0.00 0.00 0.00 17.79 19.43 1x02 h ALA 10 CO -0.80 -0.44 0.49 0.93 0.00 0.00 0.00 179.25 179.43 1x02 h GLU 11 N -0.02 0.91 0.00 0.00 4.39 -0.18 -0.41 114.58 119.27 1x02 h GLU 11 Ca 0.01 -0.05 0.00 0.00 0.34 0.00 0.00 59.36 59.65 1x02 h GLU 11 Cb 0.05 -0.20 0.00 0.00 -0.10 0.00 0.00 28.75 28.50 1x02 h GLU 11 CO -0.00 0.60 0.00 0.74 -1.16 0.00 0.00 179.01 179.19 1x02 h PHE 12 N 0.94 0.00 0.12 4.33 0.04 -0.90 -3.16 116.94 118.31 1x02 h PHE 12 Ca 0.32 0.00 -0.01 0.00 2.80 0.00 0.00 57.97 61.09 1x02 h PHE 12 Cb 0.07 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.22 1x02 h PHE 12 CO -0.04 0.00 -0.06 -0.22 -0.60 0.00 0.00 178.31 177.40 1x02 h LYS 13 N 0.00 -0.16 -0.71 1.51 3.64 0.88 -3.04 116.57 118.69 1x02 h LYS 13 Ca 0.00 0.01 0.14 0.00 -1.27 0.00 0.00 60.65 59.53 1x02 h LYS 13 Cb 0.70 0.04 -0.13 0.00 -0.41 0.00 0.00 32.23 32.42 1x02 h LYS 13 CO 0.00 -0.10 -0.19 0.93 -2.27 0.00 0.00 179.45 177.81 1x02 h GLU 14 N -0.87 -0.01 0.00 1.90 5.08 -1.31 1.15 114.58 120.52 1x02 h GLU 14 Ca -0.02 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.34 1x02 h GLU 14 Cb 0.12 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.38 1x02 h GLU 14 CO 0.03 -0.01 -0.01 0.00 -1.00 0.00 0.00 179.01 178.02 1x02 h ALA 15 N 1.65 1.46 -0.01 3.43 0.00 -1.69 0.58 119.26 124.69 1x02 h ALA 15 Ca 0.33 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.24 1x02 h ALA 15 Cb 0.53 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.32 1x02 h ALA 15 CO -0.74 0.01 -0.43 0.34 0.00 0.00 0.00 179.25 178.44 1x02 n PHE 16 N -3.77 0.00 -0.02 0.00 7.35 0.34 -3.96 117.46 117.41 1x02 n PHE 16 Ca -0.03 0.00 -0.12 0.00 -0.76 0.00 0.00 57.45 56.54 1x02 n PHE 16 Cb 0.09 -0.03 -0.14 0.00 0.35 0.00 0.00 39.48 39.75 1x02 n PHE 16 CO 0.00 0.00 0.00 0.43 -0.76 0.00 0.00 176.76 176.43 1x02 n SER 17 N -0.16 1.16 0.07 -2.13 7.64 0.18 -3.53 113.62 116.86 1x02 n SER 17 Ca 0.10 0.32 -0.13 0.00 1.01 0.00 0.00 58.87 60.17 1x02 n SER 17 Cb 0.44 -0.21 -0.05 0.00 -1.01 0.00 0.00 64.21 63.39 1x02 n SER 17 CO 0.00 0.00 0.00 0.17 -3.01 0.00 0.00 175.04 172.20 1x02 h LEU 18 N 0.02 0.47 -0.14 -3.43 -0.00 -1.58 -3.30 115.31 107.34 1x02 h LEU 18 Ca -0.35 -0.38 -0.03 0.00 -0.00 0.00 0.00 57.88 57.12 1x02 h LEU 18 Cb 2.03 -0.14 -0.00 0.00 -0.00 0.00 0.00 40.66 42.54 1x02 h LEU 18 CO 0.07 1.19 -0.02 -0.26 -0.00 0.00 0.00 178.44 179.42 1x02 h PHE 19 N 0.19 0.30 -1.17 0.17 0.04 -1.73 -3.38 116.94 111.37 1x02 h PHE 19 Ca -0.08 -0.06 -0.43 0.00 2.80 0.00 0.00 57.97 60.20 1x02 h PHE 19 Cb 1.59 -0.07 -0.06 0.00 2.20 0.00 0.00 35.95 39.61 1x02 h PHE 19 CO 0.05 0.54 1.07 0.34 -0.60 0.00 0.00 178.31 179.71 1x02 s ASP 20 N -5.83 5.62 -0.05 2.17 -1.08 -1.23 -4.62 116.67 111.63 1x02 s ASP 20 Ca -0.14 -0.70 -0.23 0.00 -0.52 0.00 0.00 52.55 50.95 1x02 s ASP 20 Cb 0.05 -2.56 -0.28 0.00 -1.46 0.00 0.00 42.92 38.68 1x02 s ASP 20 CO 0.72 -2.28 0.93 0.11 0.52 0.00 0.00 175.17 175.18 1x02 h LYS 21 N 11.36 0.25 -0.54 4.34 1.79 -1.82 -3.33 116.57 128.63 1x02 h LYS 21 Ca 0.04 -0.37 0.04 0.00 -2.18 0.00 0.00 60.65 58.18 1x02 h LYS 21 Cb 1.04 0.13 -0.04 0.00 -1.58 0.00 0.00 32.23 31.77 1x02 h LYS 21 CO 1.28 1.13 0.30 0.38 -1.08 0.00 0.00 179.45 181.45 1x02 h ASP 22 N -0.44 0.45 -0.63 0.86 3.04 -1.95 -3.47 116.42 114.28 1x02 h ASP 22 Ca -0.09 0.02 0.00 0.00 -3.24 0.00 0.00 57.03 53.72 1x02 h ASP 22 Cb 1.38 -0.07 0.00 0.00 -1.04 0.00 0.00 39.33 39.60 1x02 h ASP 22 CO 0.11 0.31 0.00 0.61 -2.04 0.00 0.00 179.24 178.22 1x02 n GLY 23 N -1.25 0.61 0.60 7.15 0.00 -1.25 -5.04 105.19 106.00 1x02 n GLY 23 Ca 0.05 -0.19 -0.11 0.00 0.00 0.00 0.00 46.02 45.77 1x02 n GLY 23 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1x02 n ASP 24 N -0.13 1.06 0.00 1.61 5.68 -1.26 -5.06 116.55 118.45 1x02 n ASP 24 Ca 0.00 0.10 0.00 0.00 -0.50 0.00 0.00 54.79 54.39 1x02 n ASP 24 Cb 0.18 -0.29 0.00 0.00 -1.14 0.00 0.00 41.12 39.87 1x02 n ASP 24 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1x02 n GLY 25 N 2.44 0.66 3.50 6.12 0.00 -1.26 -5.11 105.19 111.53 1x02 n GLY 25 Ca -0.20 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.70 1x02 n GLY 25 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1x02 s THR 26 N -0.81 -0.00 -1.02 2.61 -4.23 -1.26 -3.93 115.64 106.99 1x02 s THR 26 Ca 0.00 0.01 -0.12 0.00 -1.18 0.00 0.00 61.69 60.40 1x02 s THR 26 Cb 0.00 -0.83 0.24 0.00 1.34 0.00 0.00 72.50 73.25 1x02 s THR 26 CO 0.00 0.00 1.04 -0.63 -0.54 0.00 0.00 174.62 174.50 1x02 s ILE 27 N 0.62 5.69 0.49 2.99 1.01 0.10 -4.81 121.20 127.29 1x02 s ILE 27 Ca -0.02 -2.92 -0.11 0.00 0.00 0.00 0.00 60.65 57.60 1x02 s ILE 27 Cb -0.05 -4.61 -0.06 0.00 0.01 0.00 0.00 42.46 37.76 1x02 s ILE 27 CO -0.04 -1.21 0.87 0.42 0.00 0.00 0.00 174.94 174.99 1x02 s THR 28 N -0.23 4.74 0.54 2.92 -4.23 -1.26 -4.02 115.64 114.09 1x02 s THR 28 Ca 0.28 0.72 0.47 0.00 -1.18 0.00 0.00 61.69 61.98 1x02 s THR 28 Cb -0.09 -3.79 0.70 0.00 1.34 0.00 0.00 72.50 70.66 1x02 s THR 28 CO -0.08 -0.76 1.58 0.71 -0.54 0.00 0.00 174.62 175.54 1x02 h THR 29 N 0.57 0.02 -0.42 3.99 1.35 -1.92 1.64 112.91 118.15 1x02 h THR 29 Ca -0.46 -0.00 -0.12 0.00 -0.55 0.00 0.00 66.41 65.28 1x02 h THR 29 Cb 1.19 0.02 -0.01 0.00 -1.73 0.00 0.00 68.15 67.62 1x02 h THR 29 CO 0.62 0.00 -0.19 0.50 -0.25 0.00 0.00 175.52 176.20 1x02 h LYS 30 N 0.00 0.87 0.18 4.72 3.64 -1.96 0.61 116.57 124.62 1x02 h LYS 30 Ca 0.92 -0.37 -0.31 0.00 -1.27 0.00 0.00 60.65 59.61 1x02 h LYS 30 Cb 3.56 -0.03 0.01 0.00 -0.41 0.00 0.00 32.23 35.37 1x02 h LYS 30 CO -0.09 1.02 -1.45 0.93 -2.27 0.00 0.00 179.45 177.59 1x02 h GLU 31 N 0.69 0.37 0.06 1.90 5.08 0.19 -3.17 114.58 119.70 1x02 h GLU 31 Ca 0.09 -0.64 -0.00 0.00 -1.00 0.00 0.00 59.36 57.81 1x02 h GLU 31 Cb 0.75 0.24 0.00 0.00 0.50 0.00 0.00 28.75 30.24 1x02 h GLU 31 CO 0.06 1.28 -0.03 1.25 -1.00 0.00 0.00 179.01 180.58 1x02 h LEU 32 N 0.10 -0.06 -1.51 1.33 5.85 -0.56 -3.18 115.31 117.27 1x02 h LEU 32 Ca -0.22 -0.58 0.00 0.00 0.84 0.00 0.00 57.88 57.92 1x02 h LEU 32 Cb 2.07 0.02 0.00 0.00 0.37 0.00 0.00 40.66 43.11 1x02 h LEU 32 CO 0.22 0.61 0.02 1.23 -0.34 0.00 0.00 178.44 180.18 1x02 h GLY 33 N -0.81 0.00 2.00 3.75 0.00 0.07 0.60 103.07 108.68 1x02 h GLY 33 Ca -0.01 0.00 -0.19 0.00 0.00 0.00 0.00 47.33 47.14 1x02 h GLY 33 CO 0.01 0.00 -0.88 0.00 0.00 0.00 0.00 176.54 175.67 1x02 h THR 34 N 0.00 1.55 0.01 4.70 1.03 -1.53 -3.11 112.91 115.55 1x02 h THR 34 Ca 0.00 -3.11 -0.36 0.00 -0.01 0.00 0.00 66.41 62.93 1x02 h THR 34 Cb 0.04 2.72 -0.06 0.00 -1.07 0.00 0.00 68.15 69.77 1x02 h THR 34 CO 0.00 0.87 -2.24 0.52 -0.01 0.00 0.00 175.52 174.65 1x02 n VAL 35 N -3.36 1.47 -0.01 0.00 0.31 -0.13 -4.12 118.33 112.48 1x02 n VAL 35 Ca 0.00 -0.80 -0.11 0.00 -0.01 0.00 0.00 64.34 63.42 1x02 n VAL 35 Cb 0.88 -0.78 -0.06 0.00 -0.91 0.00 0.00 33.84 32.97 1x02 n VAL 35 CO 0.00 0.00 0.00 0.24 -1.32 0.00 0.00 176.83 175.75 1x02 h MET 36 N 0.00 0.15 0.00 5.55 2.86 -1.09 -2.10 114.93 120.31 1x02 h MET 36 Ca -0.49 -0.02 -0.01 0.00 -2.06 0.00 0.00 59.70 57.12 1x02 h MET 36 Cb 2.14 -0.03 -0.00 0.00 0.06 0.00 0.00 31.60 33.77 1x02 h MET 36 CO 0.03 0.20 -0.03 0.07 1.06 0.00 0.00 176.91 178.24 1x02 h ARG 37 N 0.06 0.00 -0.44 1.72 -0.00 -1.75 -1.92 114.38 112.05 1x02 h ARG 37 Ca 0.04 0.00 -0.10 0.00 -0.00 0.00 0.00 59.98 59.92 1x02 h ARG 37 Cb 0.10 0.00 -0.02 0.00 -0.00 0.00 0.00 29.97 30.05 1x02 h ARG 37 CO -0.01 0.03 -0.12 0.77 -0.00 0.00 0.00 179.97 180.64 1x02 h SER 38 N 0.00 0.80 0.75 0.08 0.02 -1.53 -2.98 113.55 110.68 1x02 h SER 38 Ca -0.00 -0.25 -0.23 0.00 -0.84 0.00 0.00 61.79 60.47 1x02 h SER 38 Cb 0.16 -0.22 -0.01 0.00 0.14 0.00 0.00 62.40 62.47 1x02 h SER 38 CO 0.00 0.94 -1.06 -0.07 -1.14 0.00 0.00 176.83 175.50 1x02 h LEU 39 N 0.72 0.23 0.00 5.07 3.38 -1.31 -3.47 115.31 119.93 1x02 h LEU 39 Ca 0.12 -0.23 0.00 0.00 0.09 0.00 0.00 57.88 57.86 1x02 h LEU 39 Cb 0.61 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 41.29 1x02 h LEU 39 CO 0.04 1.13 0.00 0.61 0.09 0.00 0.00 178.44 180.32 1x02 n GLY 40 N 1.29 1.19 0.00 0.83 0.00 -1.04 -5.09 105.19 102.37 1x02 n GLY 40 Ca -0.04 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.98 1x02 n GLY 40 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1x02 n GLN 41 N 0.00 0.00 -3.29 1.61 6.02 -0.91 -5.00 117.38 115.81 1x02 n GLN 41 Ca 0.00 0.10 -0.15 0.00 -0.01 0.00 0.00 57.00 56.94 1x02 n GLN 41 Cb 0.00 -0.55 0.08 0.00 1.02 0.00 0.00 30.24 30.79 1x02 n GLN 41 CO 0.00 0.00 0.00 -1.71 -1.01 0.00 0.00 177.06 174.34 1x02 n ASN 42 N -2.23 -3.09 -4.77 1.08 4.05 -1.26 -4.90 115.26 104.14 1x02 n ASN 42 Ca 0.00 -0.60 -0.38 0.00 0.45 0.00 0.00 54.58 54.05 1x02 n ASN 42 Cb 0.00 -4.85 -0.01 0.00 1.23 0.00 0.00 39.78 36.15 1x02 n ASN 42 CO 0.00 0.00 0.00 -2.16 -3.05 0.00 0.00 177.26 172.05 1x02 s PRO 43 N -5.03 3.92 0.75 1.20 0.04 -1.26 -5.02 135.00 129.60 1x02 s PRO 43 Ca 0.10 1.84 -0.11 0.00 0.04 0.00 0.00 61.00 62.88 1x02 s PRO 43 Cb -0.01 -2.57 0.04 0.00 0.04 0.00 0.00 34.50 31.99 1x02 s PRO 43 CO 0.68 -0.43 1.08 0.95 0.04 0.00 0.00 177.00 179.32 1x02 s THR 44 N -1.45 3.52 0.16 1.26 -4.23 -1.26 -4.65 115.64 108.98 1x02 s THR 44 Ca 0.60 0.49 -0.30 0.00 -1.18 0.00 0.00 61.69 61.30 1x02 s THR 44 Cb -0.31 -3.25 -0.05 0.00 1.34 0.00 0.00 72.50 70.24 1x02 s THR 44 CO 0.38 -0.65 1.55 -0.33 -0.54 0.00 0.00 174.62 175.03 1x02 h GLU 45 N -0.91 -0.17 -1.03 3.99 5.08 -1.99 0.51 114.58 120.07 1x02 h GLU 45 Ca -0.45 0.01 0.31 0.00 -1.00 0.00 0.00 59.36 58.23 1x02 h GLU 45 Cb 1.24 0.04 -0.14 0.00 0.50 0.00 0.00 28.75 30.39 1x02 h GLU 45 CO 0.58 -0.11 0.61 0.00 -1.00 0.00 0.00 179.01 179.09 1x02 h ALA 46 N 0.38 2.01 0.30 3.43 0.00 -1.99 0.22 119.26 123.61 1x02 h ALA 46 Ca 0.14 0.16 -0.01 0.00 0.00 0.00 0.00 54.91 55.20 1x02 h ALA 46 Cb 0.51 0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.42 1x02 h ALA 46 CO -0.79 -0.57 -0.15 0.93 0.00 0.00 0.00 179.25 178.67 1x02 h GLU 47 N 0.37 -0.39 -0.36 0.00 4.39 -0.43 -1.58 114.58 116.58 1x02 h GLU 47 Ca 0.71 0.03 0.07 0.00 0.34 0.00 0.00 59.36 60.51 1x02 h GLU 47 Cb 1.63 0.09 -0.07 0.00 -0.10 0.00 0.00 28.75 30.30 1x02 h GLU 47 CO -0.54 -0.06 -0.11 -0.07 -1.16 0.00 0.00 179.01 177.08 1x02 h LEU 48 N -0.91 -0.39 -0.60 1.33 3.38 0.39 -0.25 115.31 118.25 1x02 h LEU 48 Ca -0.04 0.12 0.01 0.00 0.09 0.00 0.00 57.88 58.05 1x02 h LEU 48 Cb 0.51 0.25 -0.03 0.00 0.09 0.00 0.00 40.66 41.48 1x02 h LEU 48 CO 0.07 -0.14 0.39 1.56 0.09 0.00 0.00 178.44 180.41 1x02 h GLN 49 N -0.03 0.77 -0.67 1.13 1.08 -0.70 -0.83 115.11 115.86 1x02 h GLN 49 Ca 0.17 -0.05 0.04 0.00 -1.45 0.00 0.00 58.65 57.37 1x02 h GLN 49 Cb 0.30 -0.17 -0.05 0.00 -0.05 0.00 0.00 27.48 27.50 1x02 h GLN 49 CO -0.38 0.51 0.40 -0.44 -0.95 0.00 0.00 178.83 177.97 1x02 h ASP 50 N 0.80 0.63 0.03 1.46 3.32 -0.34 0.50 116.42 122.82 1x02 h ASP 50 Ca 0.22 0.01 -0.00 0.00 0.02 0.00 0.00 57.03 57.28 1x02 h ASP 50 Cb -0.08 -0.12 0.00 0.00 0.22 0.00 0.00 39.33 39.35 1x02 h ASP 50 CO -0.06 0.43 -0.01 0.24 -1.72 0.00 0.00 179.24 178.12 1x02 h MET 51 N 0.77 -0.04 -0.25 3.56 2.86 -0.64 -2.38 114.93 118.81 1x02 h MET 51 Ca 0.28 0.00 -0.05 0.00 -2.06 0.00 0.00 59.70 57.88 1x02 h MET 51 Cb 0.09 0.01 -0.01 0.00 0.06 0.00 0.00 31.60 31.74 1x02 h MET 51 CO -0.14 0.24 -0.06 0.82 1.06 0.00 0.00 176.91 178.83 1x02 h ILE 52 N -0.31 1.19 -0.61 -1.22 2.04 -0.90 -2.72 117.51 114.98 1x02 h ILE 52 Ca -0.00 -0.78 -0.03 0.00 1.00 0.00 0.00 64.86 65.05 1x02 h ILE 52 Cb 0.29 1.06 -0.03 0.00 -0.74 0.00 0.00 36.82 37.41 1x02 h ILE 52 CO 0.01 0.26 0.25 0.78 0.00 0.00 0.00 178.15 179.44 1x02 h ASN 53 N 0.38 0.84 -0.59 1.72 2.35 0.13 0.49 115.58 120.90 1x02 h ASN 53 Ca 0.08 -0.17 0.12 0.00 -0.55 0.00 0.00 56.30 55.78 1x02 h ASN 53 Cb 0.35 -0.22 -0.10 0.00 0.05 0.00 0.00 38.32 38.40 1x02 h ASN 53 CO 0.02 0.77 0.03 -0.33 -1.65 0.00 0.00 177.43 176.27 1x02 h GLU 54 N 0.84 0.14 0.11 0.81 4.39 -1.10 -2.00 114.58 117.78 1x02 h GLU 54 Ca 0.20 -0.01 -0.28 0.00 0.34 0.00 0.00 59.36 59.61 1x02 h GLU 54 Cb 0.20 -0.03 -0.01 0.00 -0.10 0.00 0.00 28.75 28.81 1x02 h GLU 54 CO -0.02 0.09 -1.36 0.28 -1.16 0.00 0.00 179.01 176.85 1x02 h VAL 55 N 0.15 1.35 0.00 3.13 2.07 -1.55 -3.45 116.25 117.94 1x02 h VAL 55 Ca 0.31 -2.97 -0.36 0.00 0.82 0.00 0.00 66.70 64.50 1x02 h VAL 55 Cb 0.48 2.84 -0.07 0.00 -1.52 0.00 0.00 31.29 33.02 1x02 h VAL 55 CO -0.48 0.85 1.35 -0.67 0.02 0.00 0.00 177.57 178.65 1x02 n ASP 56 N -3.46 -0.02 -0.06 0.57 2.03 0.17 -4.76 116.55 111.02 1x02 n ASP 56 Ca -0.11 0.04 -0.03 0.00 0.52 0.00 0.00 54.79 55.20 1x02 n ASP 56 Cb 1.03 -0.64 -0.01 0.00 -0.72 0.00 0.00 41.12 40.78 1x02 n ASP 56 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1x02 h ALA 57 N 8.84 0.00 -0.96 -1.67 0.00 -1.88 -3.38 119.26 120.22 1x02 h ALA 57 Ca -0.03 -0.38 0.27 0.00 0.00 0.00 0.00 54.91 54.77 1x02 h ALA 57 Cb 0.96 0.36 -0.14 0.00 0.00 0.00 0.00 17.79 18.97 1x02 h ALA 57 CO 1.07 0.36 0.47 0.38 0.00 0.00 0.00 179.25 181.54 1x02 h ASP 58 N -0.93 0.41 0.00 0.00 3.04 -1.92 -3.45 116.42 113.56 1x02 h ASP 58 Ca 0.00 0.17 0.00 0.00 -3.24 0.00 0.00 57.03 53.96 1x02 h ASP 58 Cb 0.36 0.14 0.00 0.00 -1.04 0.00 0.00 39.33 38.79 1x02 h ASP 58 CO 0.00 -0.06 0.00 0.61 -2.04 0.00 0.00 179.24 177.75 1x02 n GLY 59 N -1.32 0.99 0.49 7.15 0.00 -1.26 -5.04 105.19 106.20 1x02 n GLY 59 Ca 0.27 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.29 1x02 n GLY 59 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1x02 n ASN 60 N 0.00 2.04 0.00 1.61 0.23 -1.26 -5.07 115.26 112.81 1x02 n ASN 60 Ca 0.00 0.00 0.00 0.00 -0.53 0.00 0.00 54.58 54.05 1x02 n ASN 60 Cb 0.00 0.00 0.00 0.00 -2.08 0.00 0.00 39.78 37.70 1x02 n ASN 60 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1x02 n GLY 61 N 3.21 1.35 3.16 4.83 0.00 -1.26 -5.12 105.19 111.36 1x02 n GLY 61 Ca 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.90 1x02 n GLY 61 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1x02 s THR 62 N -2.00 -0.03 -0.42 2.61 -4.23 -1.26 -4.89 115.64 105.42 1x02 s THR 62 Ca 0.00 0.12 -0.21 0.00 -1.18 0.00 0.00 61.69 60.42 1x02 s THR 62 Cb 0.00 -0.49 0.02 0.00 1.34 0.00 0.00 72.50 73.37 1x02 s THR 62 CO 0.00 0.05 0.66 -0.63 -0.54 0.00 0.00 174.62 174.16 1x02 s ILE 63 N 1.28 4.81 0.18 2.99 1.01 -1.26 -4.84 121.20 125.38 1x02 s ILE 63 Ca -0.09 0.28 -0.02 0.00 0.00 0.00 0.00 60.65 60.82 1x02 s ILE 63 Cb -0.09 -4.19 0.04 0.00 0.01 0.00 0.00 42.46 38.23 1x02 s ILE 63 CO -0.10 -0.55 0.25 -0.90 0.00 0.00 0.00 174.94 173.64 1x02 n ASP 64 N 6.28 0.13 -0.16 3.58 5.68 -1.26 0.02 116.55 130.82 1x02 n ASP 64 Ca -0.01 -1.16 -0.02 0.00 -0.50 0.00 0.00 54.79 53.10 1x02 n ASP 64 Cb 0.48 -0.18 0.06 0.00 -1.14 0.00 0.00 41.12 40.34 1x02 n ASP 64 CO 0.00 0.00 0.00 0.15 -1.33 0.00 0.00 177.20 176.02 1x02 h PHE 65 N -0.85 -0.02 0.26 2.11 3.57 -1.97 0.69 116.94 120.73 1x02 h PHE 65 Ca -0.08 0.04 -0.01 0.00 3.53 0.00 0.00 57.97 61.44 1x02 h PHE 65 Cb 0.25 0.09 0.00 0.00 2.79 0.00 0.00 35.95 39.08 1x02 h PHE 65 CO 0.00 -0.11 -0.12 -1.00 -2.23 0.00 0.00 178.31 174.85 1x02 h PRO 66 N 0.12 -0.33 -0.94 6.41 0.13 -1.94 -3.20 132.00 132.25 1x02 h PRO 66 Ca 0.25 0.02 0.22 0.00 -0.87 0.00 0.00 66.00 65.63 1x02 h PRO 66 Cb 0.38 0.08 -0.07 0.00 0.13 0.00 0.00 31.00 31.51 1x02 h PRO 66 CO -0.41 0.02 0.62 0.93 -0.23 0.00 0.00 178.00 178.93 1x02 h GLU 67 N -0.83 0.35 -0.88 0.86 5.08 -1.87 0.87 114.58 118.15 1x02 h GLU 67 Ca -0.04 -0.02 0.07 0.00 -1.00 0.00 0.00 59.36 58.37 1x02 h GLU 67 Cb 0.51 -0.08 -0.07 0.00 0.50 0.00 0.00 28.75 29.62 1x02 h GLU 67 CO 0.06 0.23 0.55 0.35 -1.00 0.00 0.00 179.01 179.20 1x02 h PHE 68 N 0.36 1.01 -0.12 4.33 3.04 -0.85 -0.27 116.94 124.44 1x02 h PHE 68 Ca 0.49 0.03 0.03 0.00 3.98 0.00 0.00 57.97 62.51 1x02 h PHE 68 Cb 1.31 -0.32 -0.00 0.00 2.56 0.00 0.00 35.95 39.49 1x02 h PHE 68 CO -0.00 0.49 0.09 -0.07 -2.02 0.00 0.00 178.31 176.80 1x02 h LEU 69 N 0.97 0.00 0.10 0.59 4.07 -0.87 -2.23 115.31 117.94 1x02 h LEU 69 Ca 0.39 0.00 -0.01 0.00 0.08 0.00 0.00 57.88 58.35 1x02 h LEU 69 Cb 0.22 0.00 0.00 0.00 1.08 0.00 0.00 40.66 41.96 1x02 h LEU 69 CO -0.19 0.00 -0.05 0.74 -1.08 0.00 0.00 178.44 177.86 1x02 h THR 70 N 0.00 1.11 -0.81 0.22 2.02 -1.06 -3.08 112.91 111.30 1x02 h THR 70 Ca 0.06 -1.16 0.11 0.00 0.77 0.00 0.00 66.41 66.19 1x02 h THR 70 Cb 0.24 1.81 -0.08 0.00 -1.74 0.00 0.00 68.15 68.38 1x02 h THR 70 CO -0.00 0.27 0.43 -0.03 0.37 0.00 0.00 175.52 176.56 1x02 h MET 71 N -0.71 0.67 -0.14 6.66 1.85 -1.20 -1.56 114.93 120.50 1x02 h MET 71 Ca -0.01 -0.04 0.05 0.00 -0.61 0.00 0.00 59.70 59.08 1x02 h MET 71 Cb 0.54 -0.15 -0.05 0.00 0.43 0.00 0.00 31.60 32.37 1x02 h MET 71 CO 0.02 0.44 -0.18 0.52 -0.40 0.00 0.00 176.91 177.32 1x02 h MET 72 N 0.69 -0.21 0.01 0.39 2.07 -1.46 1.92 114.93 118.34 1x02 h MET 72 Ca 0.41 0.01 0.01 0.00 -2.07 0.00 0.00 59.70 58.06 1x02 h MET 72 Cb 0.46 0.05 -0.01 0.00 -1.87 0.00 0.00 31.60 30.23 1x02 h MET 72 CO -0.29 -0.14 -0.04 0.00 1.07 0.00 0.00 176.91 177.50 1x02 h ALA 73 N 0.82 -0.05 0.00 6.32 0.00 -1.29 0.11 119.26 125.16 1x02 h ALA 73 Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.01 1x02 h ALA 73 Cb 0.37 0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.24 1x02 h ALA 73 CO -0.27 -0.54 0.00 0.00 0.00 0.00 0.00 179.25 178.43 1x02 h ARG 74 N -0.09 0.00 -0.01 0.00 3.08 -0.93 -2.40 114.38 114.03 1x02 h ARG 74 Ca 0.02 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.07 1x02 h ARG 74 Cb 0.10 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.15 1x02 h ARG 74 CO -0.04 0.00 -0.20 1.17 -1.07 0.00 0.00 179.97 179.83 1x02 n LYS 75 N -2.97 1.19 -0.08 0.04 3.00 0.65 -3.49 118.16 116.49 1x02 n LYS 75 Ca 0.01 -0.77 -0.23 0.00 -0.00 0.00 0.00 58.31 57.33 1x02 n LYS 75 Cb 0.33 -1.48 -0.12 0.00 0.00 0.00 0.00 35.03 33.76 1x02 n LYS 75 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.40 176.07 1x02 n MET 76 N -0.23 0.65 0.05 1.64 2.81 0.31 -4.37 117.12 117.98 1x02 n MET 76 Ca 0.14 0.32 -0.06 0.00 -1.81 0.00 0.00 57.70 56.29 1x02 n MET 76 Cb 0.38 -1.63 0.14 0.00 -0.71 0.00 0.00 33.22 31.40 1x02 n MET 76 CO 0.00 0.00 0.00 1.57 1.51 0.00 0.00 175.97 179.05 1x02 h LYS 77 N -0.44 0.38 -0.97 0.03 5.09 -1.69 -3.19 116.57 115.78 1x02 h LYS 77 Ca -0.50 -0.21 0.30 0.00 0.09 0.00 0.00 60.65 60.32 1x02 h LYS 77 Cb 1.73 0.01 -0.18 0.00 0.10 0.00 0.00 32.23 33.90 1x02 h LYS 77 CO -0.14 0.78 0.13 -0.25 -2.09 0.00 0.00 179.45 177.89 1x02 n ASP 78 N -3.98 -0.01 -0.03 7.07 9.92 -1.23 0.07 116.55 128.36 1x02 n ASP 78 Ca -0.02 1.63 -0.14 0.00 -0.53 0.00 0.00 54.79 55.73 1x02 n ASP 78 Cb 0.54 -0.64 -0.10 0.00 -0.64 0.00 0.00 41.12 40.29 1x02 n ASP 78 CO 0.00 0.00 0.00 0.71 0.13 0.00 0.00 177.20 178.04 1x02 h THR 79 N 0.00 1.47 -5.71 -3.53 1.35 -1.79 -3.48 112.91 101.21 1x02 h THR 79 Ca 0.64 -1.61 -0.35 0.00 -0.55 0.00 0.00 66.41 64.54 1x02 h THR 79 Cb 1.42 2.42 0.15 0.00 -1.73 0.00 0.00 68.15 70.42 1x02 h THR 79 CO -0.87 0.44 -0.77 -0.67 -0.25 0.00 0.00 175.52 173.40 1x02 n ASP 80 N -4.60 -2.34 -1.84 5.36 2.03 0.11 -1.56 116.55 113.71 1x02 n ASP 80 Ca -0.09 -0.63 -0.19 0.00 0.52 0.00 0.00 54.79 54.40 1x02 n ASP 80 Cb 0.41 -5.01 -0.05 0.00 -0.72 0.00 0.00 41.12 35.76 1x02 n ASP 80 CO 0.00 0.00 0.00 -1.20 -1.92 0.00 0.00 177.20 174.08 1x02 n SER 81 N -3.11 -5.43 -0.10 1.67 7.64 -1.26 -4.88 113.62 108.14 1x02 n SER 81 Ca -0.26 0.23 -0.19 0.00 1.01 0.00 0.00 58.87 59.66 1x02 n SER 81 Cb 0.66 -4.55 -0.09 0.00 -1.01 0.00 0.00 64.21 59.22 1x02 n SER 81 CO 0.00 0.00 0.00 1.21 -3.01 0.00 0.00 175.04 173.24 1x02 n GLU 82 N -2.65 0.54 -0.10 1.43 2.13 -0.60 -4.08 120.64 117.31 1x02 n GLU 82 Ca -0.21 0.53 -0.14 0.00 0.66 0.00 0.00 57.16 58.00 1x02 n GLU 82 Cb 0.65 -1.70 -0.03 0.00 0.27 0.00 0.00 31.44 30.62 1x02 n GLU 82 CO 0.00 0.00 0.00 0.93 -0.41 0.00 0.00 177.13 177.65 1x02 h GLU 83 N -1.00 0.87 -0.77 5.31 5.08 -1.90 -2.68 114.58 119.48 1x02 h GLU 83 Ca -0.31 -0.49 0.22 0.00 -1.00 0.00 0.00 59.36 57.78 1x02 h GLU 83 Cb 1.18 0.04 -0.03 0.00 0.50 0.00 0.00 28.75 30.43 1x02 h GLU 83 CO -0.19 1.13 0.56 0.93 -1.00 0.00 0.00 179.01 180.44 1x02 h GLU 84 N 0.66 0.01 0.18 2.33 4.39 -1.94 -0.27 114.58 119.94 1x02 h GLU 84 Ca 0.04 -0.00 -0.34 0.00 0.34 0.00 0.00 59.36 59.40 1x02 h GLU 84 Cb 1.02 -0.00 0.01 0.00 -0.10 0.00 0.00 28.75 29.68 1x02 h GLU 84 CO 0.10 0.00 -1.68 0.82 -1.16 0.00 0.00 179.01 177.10 1x02 h ILE 85 N 0.01 1.02 -0.84 3.13 2.04 -1.67 -3.38 117.51 117.82 1x02 h ILE 85 Ca 0.37 -2.59 0.08 0.00 1.00 0.00 0.00 64.86 63.72 1x02 h ILE 85 Cb 1.47 2.80 -0.11 0.00 -0.74 0.00 0.00 36.82 40.24 1x02 h ILE 85 CO -0.01 0.84 -0.47 0.54 0.00 0.00 0.00 178.15 179.06 1x02 n ARG 86 N -3.58 -0.35 -0.31 2.37 5.12 -0.11 0.67 116.66 120.47 1x02 n ARG 86 Ca -0.22 1.28 0.05 0.00 -1.93 0.00 0.00 57.85 57.02 1x02 n ARG 86 Cb 1.07 -1.88 0.14 0.00 -1.16 0.00 0.00 32.46 30.63 1x02 n ARG 86 CO 0.00 0.00 0.00 0.93 -1.93 0.00 0.00 177.63 176.63 1x02 h GLU 87 N 0.00 0.01 -0.55 5.56 4.39 -1.73 0.41 114.58 122.68 1x02 h GLU 87 Ca 0.16 -0.00 0.03 0.00 0.34 0.00 0.00 59.36 59.89 1x02 h GLU 87 Cb 0.37 -0.00 -0.04 0.00 -0.10 0.00 0.00 28.75 28.98 1x02 h GLU 87 CO -0.80 0.01 0.32 0.00 -1.16 0.00 0.00 179.01 177.37 1x02 h ALA 88 N 1.88 0.71 -0.98 3.43 0.00 0.03 -2.04 119.26 122.29 1x02 h ALA 88 Ca 0.44 -0.00 0.10 0.00 0.00 0.00 0.00 54.91 55.44 1x02 h ALA 88 Cb 0.71 -0.14 -0.07 0.00 0.00 0.00 0.00 17.79 18.29 1x02 h ALA 88 CO -0.89 0.02 0.63 0.35 0.00 0.00 0.00 179.25 179.35 1x02 h PHE 89 N 0.62 1.12 -0.44 0.00 3.57 0.61 -1.80 116.94 120.62 1x02 h PHE 89 Ca 0.23 0.03 -0.01 0.00 3.53 0.00 0.00 57.97 61.75 1x02 h PHE 89 Cb 0.06 -0.36 -0.02 0.00 2.79 0.00 0.00 35.95 38.42 1x02 h PHE 89 CO -0.07 0.51 0.25 0.00 -2.23 0.00 0.00 178.31 176.77 1x02 h ARG 90 N 1.04 0.61 -0.12 1.11 3.08 -0.57 -2.13 114.38 117.39 1x02 h ARG 90 Ca 0.46 -0.07 0.05 0.00 0.07 0.00 0.00 59.98 60.49 1x02 h ARG 90 Cb 0.36 -0.12 -0.06 0.00 0.08 0.00 0.00 29.97 30.22 1x02 h ARG 90 CO -0.21 0.47 -0.34 0.28 -1.07 0.00 0.00 179.97 179.10 1x02 h VAL 91 N 0.58 0.25 -0.39 2.04 2.07 -1.02 -2.17 116.25 117.61 1x02 h VAL 91 Ca 0.16 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.72 1x02 h VAL 91 Cb 0.03 0.25 -0.04 0.00 -1.52 0.00 0.00 31.29 30.01 1x02 h VAL 91 CO -0.03 0.00 0.14 -0.26 0.02 0.00 0.00 177.57 177.45 1x02 h PHE 92 N -0.42 0.26 -2.17 1.57 0.04 -1.41 -3.38 116.94 111.43 1x02 h PHE 92 Ca 0.09 0.02 -0.52 0.00 2.80 0.00 0.00 57.97 60.36 1x02 h PHE 92 Cb 0.57 -0.06 -0.02 0.00 2.20 0.00 0.00 35.95 38.64 1x02 h PHE 92 CO -0.42 0.11 1.38 0.34 -0.60 0.00 0.00 178.31 179.11 1x02 s ASP 93 N -5.38 5.37 0.00 2.17 -1.08 -0.81 -4.41 116.67 112.53 1x02 s ASP 93 Ca -0.13 0.86 -0.03 0.00 -0.52 0.00 0.00 52.55 52.73 1x02 s ASP 93 Cb 0.12 -2.52 -0.02 0.00 -1.46 0.00 0.00 42.92 39.05 1x02 s ASP 93 CO 0.72 -2.20 0.71 0.11 0.52 0.00 0.00 175.17 175.02 1x02 h LYS 94 N 14.95 -0.11 -0.78 4.34 1.57 -1.78 -3.29 116.57 131.48 1x02 h LYS 94 Ca -0.29 0.01 0.03 0.00 -1.87 0.00 0.00 60.65 58.53 1x02 h LYS 94 Cb 1.18 0.02 -0.04 0.00 0.08 0.00 0.00 32.23 33.48 1x02 h LYS 94 CO 1.13 -0.07 0.51 0.38 -0.57 0.00 0.00 179.45 180.83 1x02 h ASP 95 N -0.15 0.83 -1.62 0.86 2.03 -1.94 -3.47 116.42 112.97 1x02 h ASP 95 Ca -0.01 -0.01 0.00 0.00 -0.73 0.00 0.00 57.03 56.28 1x02 h ASP 95 Cb 0.08 -0.20 0.00 0.00 -0.83 0.00 0.00 39.33 38.39 1x02 h ASP 95 CO 0.02 0.58 0.00 0.61 -1.03 0.00 0.00 179.24 179.42 1x02 n GLY 96 N -1.42 0.62 0.13 7.15 0.00 -1.24 -5.01 105.19 105.42 1x02 n GLY 96 Ca 0.10 -0.54 -0.24 0.00 0.00 0.00 0.00 46.02 45.33 1x02 n GLY 96 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1x02 n ASN 97 N -0.12 1.96 0.00 1.61 6.94 -1.26 -5.03 115.26 119.36 1x02 n ASN 97 Ca 0.00 0.24 0.00 0.00 -0.02 0.00 0.00 54.58 54.80 1x02 n ASN 97 Cb 0.49 -0.77 0.00 0.00 -2.36 0.00 0.00 39.78 37.13 1x02 n ASN 97 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1x02 n GLY 98 N 1.60 1.42 3.44 4.83 0.00 -1.26 -5.13 105.19 110.10 1x02 n GLY 98 Ca -0.45 -0.10 -0.33 0.00 0.00 0.00 0.00 46.02 45.14 1x02 n GLY 98 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1x02 s TYR 99 N 0.00 2.92 -0.44 1.61 1.51 -1.26 -3.36 117.35 118.34 1x02 s TYR 99 Ca 0.00 -0.45 -0.20 0.00 -1.01 0.00 0.00 57.07 55.41 1x02 s TYR 99 Cb 0.00 -1.90 0.02 0.00 -0.11 0.00 0.00 41.96 39.97 1x02 s TYR 99 CO 0.00 -0.11 0.58 0.42 -1.11 0.00 0.00 175.55 175.34 1x02 s ILE 100 N 0.33 4.90 0.77 2.71 1.01 -0.73 -4.82 121.20 125.37 1x02 s ILE 100 Ca -0.07 -0.04 -0.11 0.00 0.00 0.00 0.00 60.65 60.43 1x02 s ILE 100 Cb -0.15 -4.16 0.06 0.00 0.01 0.00 0.00 42.46 38.22 1x02 s ILE 100 CO 0.04 -0.55 1.09 -0.94 0.00 0.00 0.00 174.94 174.58 1x02 s SER 101 N 1.96 4.53 0.08 3.58 1.04 -1.26 0.27 113.70 123.91 1x02 s SER 101 Ca 0.19 1.80 -0.25 0.00 0.48 0.00 0.00 55.95 58.17 1x02 s SER 101 Cb -0.15 -2.51 -0.10 0.00 0.10 0.00 0.00 66.02 63.36 1x02 s SER 101 CO 0.17 -2.01 1.41 0.00 0.98 0.00 0.00 173.24 173.79 1x02 h ALA 102 N -1.11 -0.83 -0.58 5.32 0.00 -1.92 -1.94 119.26 118.20 1x02 h ALA 102 Ca -0.44 -0.06 0.11 0.00 0.00 0.00 0.00 54.91 54.52 1x02 h ALA 102 Cb 1.23 0.85 -0.11 0.00 0.00 0.00 0.00 17.79 19.76 1x02 h ALA 102 CO 0.52 -0.95 -0.27 0.00 0.00 0.00 0.00 179.25 178.54 1x02 h ALA 103 N -0.69 0.10 -0.44 0.00 0.00 -1.93 0.84 119.26 117.15 1x02 h ALA 103 Ca 0.01 0.19 0.06 0.00 0.00 0.00 0.00 54.91 55.16 1x02 h ALA 103 Cb 0.53 0.67 -0.09 0.00 0.00 0.00 0.00 17.79 18.91 1x02 h ALA 103 CO -0.28 -0.59 -0.53 0.93 0.00 0.00 0.00 179.25 178.78 1x02 h GLU 104 N -0.12 -0.35 0.00 0.00 5.08 -1.78 0.38 114.58 117.78 1x02 h GLU 104 Ca 0.25 0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.64 1x02 h GLU 104 Cb 0.53 0.08 0.00 0.00 0.50 0.00 0.00 28.75 29.86 1x02 h GLU 104 CO -0.66 -0.23 0.00 1.25 -1.00 0.00 0.00 179.01 178.37 1x02 h LEU 105 N -0.37 0.00 -0.50 1.33 6.46 -0.58 -2.73 115.31 118.93 1x02 h LEU 105 Ca 0.09 0.00 -0.13 0.00 -0.12 0.00 0.00 57.88 57.73 1x02 h LEU 105 Cb 0.59 0.00 -0.01 0.00 -0.73 0.00 0.00 40.66 40.51 1x02 h LEU 105 CO -0.61 0.00 -0.19 -0.09 -0.62 0.00 0.00 178.44 176.93 1x02 h ARG 106 N 0.00 1.00 0.15 1.25 2.43 0.48 -1.42 114.38 118.27 1x02 h ARG 106 Ca 0.00 -0.42 -0.24 0.00 -0.81 0.00 0.00 59.98 58.51 1x02 h ARG 106 Cb 0.52 -0.04 0.03 0.00 -0.42 0.00 0.00 29.97 30.05 1x02 h ARG 106 CO 0.00 1.10 -1.03 1.25 -1.51 0.00 0.00 179.97 179.78 1x02 h HIS 107 N 0.86 0.74 -0.90 2.20 2.76 -0.93 -3.21 115.15 116.67 1x02 h HIS 107 Ca 0.12 -0.51 0.02 0.00 -2.20 0.00 0.00 60.37 57.79 1x02 h HIS 107 Cb 0.77 -0.04 -0.05 0.00 1.55 0.00 0.00 27.41 29.64 1x02 h HIS 107 CO 0.05 1.38 0.60 0.28 -1.30 0.00 0.00 177.93 178.94 1x02 h VAL 108 N -0.10 1.21 -0.22 5.26 2.07 -1.51 -2.62 116.25 120.34 1x02 h VAL 108 Ca -0.17 -0.41 0.01 0.00 0.82 0.00 0.00 66.70 66.95 1x02 h VAL 108 Cb 1.78 -0.10 -0.02 0.00 -1.52 0.00 0.00 31.29 31.44 1x02 h VAL 108 CO 0.19 0.22 0.10 0.24 0.02 0.00 0.00 177.57 178.35 1x02 h MET 109 N 1.20 0.22 -0.85 1.57 2.07 -1.35 -2.50 114.93 115.28 1x02 h MET 109 Ca 0.34 -0.01 0.11 0.00 -2.07 0.00 0.00 59.70 58.07 1x02 h MET 109 Cb -0.10 -0.05 -0.08 0.00 -1.87 0.00 0.00 31.60 29.50 1x02 h MET 109 CO -0.09 0.14 0.48 1.15 1.07 0.00 0.00 176.91 179.67 1x02 h THR 110 N 0.22 0.86 -0.69 2.22 2.02 -1.48 -1.44 112.91 114.62 1x02 h THR 110 Ca 0.09 -0.26 0.11 0.00 0.77 0.00 0.00 66.41 67.12 1x02 h THR 110 Cb 0.02 0.03 -0.08 0.00 -1.74 0.00 0.00 68.15 66.38 1x02 h THR 110 CO -0.06 0.14 0.29 0.78 0.37 0.00 0.00 175.52 177.04 1x02 h ASN 111 N 0.76 0.31 -0.95 4.18 4.21 -1.15 -1.38 115.58 121.57 1x02 h ASN 111 Ca 0.43 0.08 0.35 0.00 1.21 0.00 0.00 56.30 58.37 1x02 h ASN 111 Cb 0.47 0.04 -0.17 0.00 -1.12 0.00 0.00 38.32 37.54 1x02 h ASN 111 CO -0.28 0.16 0.34 0.18 -1.29 0.00 0.00 177.43 176.54 1x02 n LEU 112 N -4.96 0.18 0.00 1.61 4.77 -0.54 -4.64 117.00 113.41 1x02 n LEU 112 Ca 0.11 1.58 0.00 0.00 -0.03 0.00 0.00 56.01 57.68 1x02 n LEU 112 Cb 0.32 -0.70 0.00 0.00 -2.33 0.00 0.00 43.42 40.71 1x02 n LEU 112 CO 0.22 -1.72 0.00 0.61 -1.33 0.00 0.00 177.39 175.17 1x02 n GLY 113 N -1.33 0.07 3.49 -0.72 0.00 -0.57 -5.16 105.19 100.96 1x02 n GLY 113 Ca 0.31 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.24 1x02 n GLY 113 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1x02 s GLU 114 N 0.00 1.34 -0.45 1.61 0.41 -0.89 -5.10 118.70 115.61 1x02 s GLU 114 Ca 0.00 -0.89 -0.01 0.00 -0.41 0.00 0.00 54.97 53.65 1x02 s GLU 114 Cb 0.00 0.50 0.12 0.00 -1.78 0.00 0.00 34.13 32.97 1x02 s GLU 114 CO 0.00 -0.56 0.24 0.15 -0.49 0.00 0.00 175.26 174.60 1x02 s LYS 115 N -3.88 2.04 0.22 1.61 1.02 -1.26 -4.25 119.74 115.24 1x02 s LYS 115 Ca 0.10 -2.04 0.06 0.00 0.02 0.00 0.00 55.97 54.11 1x02 s LYS 115 Cb -0.00 -3.54 -0.04 0.00 -0.52 0.00 0.00 37.83 33.73 1x02 s LYS 115 CO -0.03 -1.08 0.16 -0.51 -0.92 0.00 0.00 175.35 172.97 1x02 s LEU 116 N 0.74 3.78 0.45 3.17 1.43 -1.26 -5.11 118.68 121.88 1x02 s LEU 116 Ca 0.11 -0.23 0.04 0.00 -1.03 0.00 0.00 54.13 53.02 1x02 s LEU 116 Cb -0.22 -2.34 -0.04 0.00 0.03 0.00 0.00 46.19 43.62 1x02 s LEU 116 CO -0.04 0.00 0.02 0.42 0.23 0.00 0.00 176.35 176.98 1x02 s THR 117 N -2.00 1.38 0.39 5.49 -4.23 -1.26 -4.99 115.64 110.44 1x02 s THR 117 Ca 0.32 -2.00 0.18 0.00 -1.18 0.00 0.00 61.69 59.01 1x02 s THR 117 Cb -0.09 -2.52 0.39 0.00 1.34 0.00 0.00 72.50 71.62 1x02 s THR 117 CO 0.24 0.00 1.77 -0.78 -0.54 0.00 0.00 174.62 175.31 1x02 h ASP 118 N 1.60 0.45 0.18 3.99 1.82 -1.99 -0.62 116.42 121.86 1x02 h ASP 118 Ca -0.43 0.09 -0.01 0.00 -0.39 0.00 0.00 57.03 56.29 1x02 h ASP 118 Cb 1.28 0.01 0.00 0.00 0.68 0.00 0.00 39.33 41.30 1x02 h ASP 118 CO 0.74 0.09 -0.09 -0.33 -1.61 0.00 0.00 179.24 178.04 1x02 h GLU 119 N 0.40 -0.23 -0.23 0.28 4.39 -1.98 0.17 114.58 117.37 1x02 h GLU 119 Ca 0.60 0.02 0.06 0.00 0.34 0.00 0.00 59.36 60.37 1x02 h GLU 119 Cb 1.50 0.05 -0.07 0.00 -0.10 0.00 0.00 28.75 30.13 1x02 h GLU 119 CO -0.30 0.09 -0.34 0.93 -1.16 0.00 0.00 179.01 178.23 1x02 h GLU 120 N -0.58 -0.34 -0.43 2.33 4.39 -1.52 -1.85 114.58 116.58 1x02 h GLU 120 Ca -0.02 0.02 -0.01 0.00 0.34 0.00 0.00 59.36 59.68 1x02 h GLU 120 Cb 0.43 0.08 -0.02 0.00 -0.10 0.00 0.00 28.75 29.14 1x02 h GLU 120 CO 0.04 -0.23 0.21 0.28 -1.16 0.00 0.00 179.01 178.16 1x02 h VAL 121 N -0.36 1.17 -0.81 3.13 2.07 -1.42 -2.86 116.25 117.18 1x02 h VAL 121 Ca 0.12 -0.48 0.20 0.00 0.82 0.00 0.00 66.70 67.35 1x02 h VAL 121 Cb 0.55 0.71 -0.14 0.00 -1.52 0.00 0.00 31.29 30.89 1x02 h VAL 121 CO -0.43 0.19 0.05 0.44 0.02 0.00 0.00 177.57 177.84 1x02 h ASP 122 N 0.55 -0.30 -0.06 0.57 3.32 -0.18 0.89 116.42 121.21 1x02 h ASP 122 Ca 0.15 0.21 -0.02 0.00 0.02 0.00 0.00 57.03 57.39 1x02 h ASP 122 Cb 0.10 0.35 -0.01 0.00 0.22 0.00 0.00 39.33 39.99 1x02 h ASP 122 CO -0.02 -0.19 0.00 -0.33 -1.72 0.00 0.00 179.24 176.98 1x02 h GLU 123 N 0.12 0.18 -0.00 3.56 5.08 -1.14 -2.60 114.58 119.78 1x02 h GLU 123 Ca 0.46 -0.02 -0.00 0.00 -1.00 0.00 0.00 59.36 58.80 1x02 h GLU 123 Cb 0.86 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 30.07 1x02 h GLU 123 CO -0.70 0.20 -0.00 1.98 -1.00 0.00 0.00 179.01 179.49 1x02 h MET 124 N 0.18 0.00 -0.96 2.33 4.05 0.72 -3.25 114.93 118.00 1x02 h MET 124 Ca 0.04 -0.00 0.23 0.00 -0.28 0.00 0.00 59.70 59.69 1x02 h MET 124 Cb 0.13 0.00 -0.07 0.00 -0.80 0.00 0.00 31.60 30.85 1x02 h MET 124 CO 0.00 0.75 0.63 0.82 0.23 0.00 0.00 176.91 179.35 1x02 h ILE 125 N -0.75 0.62 -0.06 1.77 1.08 -0.61 0.74 117.51 120.30 1x02 h ILE 125 Ca -0.00 -0.13 0.00 0.00 -0.39 0.00 0.00 64.86 64.34 1x02 h ILE 125 Cb 0.75 0.21 0.00 0.00 -3.07 0.00 0.00 36.82 34.71 1x02 h ILE 125 CO 0.00 0.07 0.00 -2.11 -0.69 0.00 0.00 178.15 175.42 1x02 n ARG 126 N -4.52 1.34 -0.00 2.37 1.85 -1.00 -0.94 116.66 115.75 1x02 n ARG 126 Ca 0.21 -0.29 -0.01 0.00 -1.00 0.00 0.00 57.85 56.77 1x02 n ARG 126 Cb 0.78 -1.50 -0.01 0.00 -1.05 0.00 0.00 32.46 30.69 1x02 n ARG 126 CO 0.00 0.00 0.00 -1.91 -0.01 0.00 0.00 177.63 175.71 1x02 n GLU 127 N 0.01 1.22 -0.07 2.89 2.13 0.25 -4.83 120.64 122.24 1x02 n GLU 127 Ca 0.03 0.00 -0.08 0.00 0.66 0.00 0.00 57.16 57.77 1x02 n GLU 127 Cb 0.30 -1.02 -0.09 0.00 0.27 0.00 0.00 31.44 30.90 1x02 n GLU 127 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1x02 n ALA 128 N -2.38 1.68 -1.54 4.31 0.00 -1.12 -4.92 120.51 116.55 1x02 n ALA 128 Ca -0.02 -0.76 -0.35 0.00 0.00 0.00 0.00 53.44 52.31 1x02 n ALA 128 Cb 0.52 0.04 -0.07 0.00 0.00 0.00 0.00 19.45 19.95 1x02 n ALA 128 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1x02 n ASP 129 N -2.65 1.70 -0.01 0.00 2.03 -0.12 -4.72 116.55 112.78 1x02 n ASP 129 Ca -0.23 -0.45 -0.01 0.00 0.52 0.00 0.00 54.79 54.62 1x02 n ASP 129 Cb 0.86 -1.41 -0.00 0.00 -0.72 0.00 0.00 41.12 39.85 1x02 n ASP 129 CO 0.00 0.00 0.00 0.40 -1.92 0.00 0.00 177.20 175.68 1x02 h ILE 130 N 7.75 0.00 -0.81 5.18 1.08 -1.86 -3.35 117.51 125.50 1x02 h ILE 130 Ca -0.17 -0.69 0.19 0.00 -0.39 0.00 0.00 64.86 63.80 1x02 h ILE 130 Cb 1.25 0.00 -0.12 0.00 -3.07 0.00 0.00 36.82 34.88 1x02 h ILE 130 CO 1.21 0.00 0.27 0.44 -0.69 0.00 0.00 178.15 179.38 1x02 h ASP 131 N -0.75 0.14 -0.60 1.72 3.32 -1.91 -3.46 116.42 114.88 1x02 h ASP 131 Ca -0.01 0.15 0.00 0.00 0.02 0.00 0.00 57.03 57.19 1x02 h ASP 131 Cb 0.04 0.17 0.00 0.00 0.22 0.00 0.00 39.33 39.77 1x02 h ASP 131 CO 0.01 -0.02 0.00 0.61 -1.72 0.00 0.00 179.24 178.12 1x02 n GLY 132 N -1.35 0.64 0.06 2.75 0.00 -1.26 -5.02 105.19 101.02 1x02 n GLY 132 Ca 0.18 -0.19 0.05 0.00 0.00 0.00 0.00 46.02 46.06 1x02 n GLY 132 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1x02 n ASP 133 N -0.08 2.00 -0.79 1.61 5.75 -1.26 -4.97 116.55 118.81 1x02 n ASP 133 Ca 0.00 -2.54 -0.09 0.00 -0.01 0.00 0.00 54.79 52.15 1x02 n ASP 133 Cb 0.18 -0.24 -0.02 0.00 -1.03 0.00 0.00 41.12 40.00 1x02 n ASP 133 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1x02 n GLY 134 N -0.95 0.64 3.25 6.12 0.00 -1.26 -5.02 105.19 107.97 1x02 n GLY 134 Ca 0.08 -0.60 -0.16 0.00 0.00 0.00 0.00 46.02 45.34 1x02 n GLY 134 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1x02 s GLN 135 N -3.40 1.04 -0.36 1.61 -0.21 -1.26 -2.85 119.66 114.23 1x02 s GLN 135 Ca 0.00 -1.33 -0.00 0.00 0.02 0.00 0.00 55.36 54.05 1x02 s GLN 135 Cb 0.00 -0.78 0.12 0.00 1.00 0.00 0.00 33.01 33.35 1x02 s GLN 135 CO 0.00 0.13 0.18 0.08 -2.12 0.00 0.00 175.29 173.56 1x02 s VAL 136 N -2.65 0.66 0.54 1.09 1.01 0.14 -4.51 120.40 116.68 1x02 s VAL 136 Ca 0.12 -1.76 -0.09 0.00 0.00 0.00 0.00 61.98 60.26 1x02 s VAL 136 Cb -0.02 -1.49 0.13 0.00 0.00 0.00 0.00 36.38 35.00 1x02 s VAL 136 CO 0.02 -0.85 0.64 -0.46 0.00 0.00 0.00 175.10 174.45 1x02 n ASN 137 N 4.25 -0.44 -0.02 3.32 0.23 -1.26 -1.77 115.26 119.57 1x02 n ASN 137 Ca 0.05 -1.12 -0.09 0.00 -0.53 0.00 0.00 54.58 52.89 1x02 n ASN 137 Cb 0.38 -0.51 -0.02 0.00 -2.08 0.00 0.00 39.78 37.54 1x02 n ASN 137 CO 0.00 0.00 0.00 0.22 -0.93 0.00 0.00 177.26 176.55 1x02 h TYR 138 N -1.62 -0.61 0.44 -2.53 3.20 -1.96 0.39 116.97 114.29 1x02 h TYR 138 Ca -0.22 0.03 -0.01 0.00 3.14 0.00 0.00 58.73 61.67 1x02 h TYR 138 Cb 0.61 0.30 -0.02 0.00 1.54 0.00 0.00 36.73 39.16 1x02 h TYR 138 CO 0.00 -0.31 -0.43 1.49 -1.64 0.00 0.00 178.16 177.27 1x02 h GLU 139 N -0.26 -0.83 -0.80 1.82 4.22 -1.92 0.46 114.58 117.27 1x02 h GLU 139 Ca 0.12 0.06 0.17 0.00 0.08 0.00 0.00 59.36 59.79 1x02 h GLU 139 Cb 0.44 0.19 -0.05 0.00 0.50 0.00 0.00 28.75 29.83 1x02 h GLU 139 CO -0.34 -0.55 0.54 0.93 -2.18 0.00 0.00 179.01 177.41 1x02 h GLU 140 N -0.86 0.35 -0.20 1.92 5.08 -1.80 0.14 114.58 119.20 1x02 h GLU 140 Ca -0.06 -0.02 -0.20 0.00 -1.00 0.00 0.00 59.36 58.08 1x02 h GLU 140 Cb 0.74 -0.08 0.00 0.00 0.50 0.00 0.00 28.75 29.92 1x02 h GLU 140 CO -0.04 0.23 -0.68 0.35 -1.00 0.00 0.00 179.01 177.86 1x02 h PHE 141 N 0.36 1.03 -0.01 4.33 3.57 0.50 -3.22 116.94 123.50 1x02 h PHE 141 Ca 0.40 -0.42 0.00 0.00 3.53 0.00 0.00 57.97 61.48 1x02 h PHE 141 Cb 1.02 -0.17 -0.00 0.00 2.79 0.00 0.00 35.95 39.59 1x02 h PHE 141 CO -0.00 1.24 0.00 0.28 -2.23 0.00 0.00 178.31 177.60 1x02 h VAL 142 N 0.56 1.00 -0.64 1.41 2.07 0.19 -2.80 116.25 118.04 1x02 h VAL 142 Ca -0.02 -0.00 0.14 0.00 0.82 0.00 0.00 66.70 67.63 1x02 h VAL 142 Cb 1.30 0.99 -0.11 0.00 -1.52 0.00 0.00 31.29 31.95 1x02 h VAL 142 CO 0.14 0.00 0.01 1.56 0.02 0.00 0.00 177.57 179.31 1x02 h GLN 143 N 0.01 0.12 -0.21 1.57 1.08 -1.44 -0.95 115.11 115.29 1x02 h GLN 143 Ca 0.00 -0.01 0.06 0.00 -1.45 0.00 0.00 58.65 57.25 1x02 h GLN 143 Cb 0.00 -0.03 -0.06 0.00 -0.05 0.00 0.00 27.48 27.34 1x02 h GLN 143 CO -0.00 0.08 -0.22 1.98 -0.95 0.00 0.00 178.83 179.71 1x02 h MET 144 N 0.13 -0.23 -0.81 1.46 1.85 -1.51 -0.99 114.93 114.83 1x02 h MET 144 Ca 0.34 0.02 0.07 0.00 -0.61 0.00 0.00 59.70 59.51 1x02 h MET 144 Cb 0.56 0.05 -0.06 0.00 0.43 0.00 0.00 31.60 32.58 1x02 h MET 144 CO -0.55 -0.15 0.49 0.52 -0.40 0.00 0.00 176.91 176.82 1x02 h MET 145 N -0.24 0.85 -1.27 0.39 2.86 -1.06 -1.85 114.93 114.61 1x02 h MET 145 Ca 0.13 -0.05 -0.56 0.00 -2.06 0.00 0.00 59.70 57.16 1x02 h MET 145 Cb 0.43 -0.19 -0.23 0.00 0.06 0.00 0.00 31.60 31.67 1x02 h MET 145 CO -0.35 0.57 0.72 0.25 1.06 0.00 0.00 176.91 179.15 1x02 n THR 146 N -4.68 3.34 -1.46 2.22 -2.24 -0.48 -4.37 114.28 106.62 1x02 n THR 146 Ca 0.12 -2.58 -0.01 0.00 -2.27 0.00 0.00 64.05 59.31 1x02 n THR 146 Cb 0.19 -1.24 0.20 0.00 -2.10 0.00 0.00 70.33 67.38 1x02 n THR 146 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1x02 n ALA 147 N -0.41 4.01 0.00 6.98 0.00 -0.48 -4.92 120.51 125.69 1x02 n ALA 147 Ca 0.51 -3.13 0.00 0.00 0.00 0.00 0.00 53.44 50.82 1x02 n ALA 147 Cb 0.60 -0.63 0.00 0.00 0.00 0.00 0.00 19.45 19.43 1x02 n ALA 147 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.50 177.86